5-[(butan-2-ylamino)methyl]-N-[5-(4-methoxy-2-methyl-5-morpholin-4-ylcarbonyl-phenyl)sulfanyl-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 5-[(butan-2-ylamino)methyl]-N-[5-(4-methoxy-2-methyl-5-morpholin-4-ylcarbonyl-phenyl)sulfanyl-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Openeye Name: N-[5-[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]sulfanylthiazol-2-yl]-5-[(sec-butylamino)methyl]-1H-pyrrole-2-carboxamide CAS Name: 5-[(butan-2-ylamino)methyl]-N-[5-[[4-methoxy-2-methyl-5-[4-morpholinyl(oxo)methyl]phenyl]thio]-2-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 5-[(butan-2-ylamino)methyl]-N-[5-[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]sulfanyl-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Traditional Name: N-[5-[[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]thio]thiazol-2-yl]-5-[(sec-butylamino)methyl]-1H-pyrrole-2-carboxamide Formula: C26H33N5O4S2 MolecularWeight: 543.70132

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=CC=C(N1)C(=O)NC2=NC=C(S2)SC3=C(C=C(C(=C3)C(=O)N4CCOCC4)OC)C

Isomeric SMILES

CCC(C)NCC1=CC=C(N1)C(=O)NC2=NC=C(S2)SC3=C(C=C(C(=C3)C(=O)N4CCOCC4)OC)C

InChI

InChI=1S/C26H33N5O4S2/c1-5-17(3)27-14-18-6-7-20(29-18)24(32)30-26-28-15-23(37-26)36-22-13-19(21(34-4)12-16(22)2)25(33)31-8-10-35-11-9-31/h6-7,12-13,15,17,27,29H,5,8-11,14H2,1-4H3,(H,28,30,32)