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

Systemtic Name: 5-(aminomethyl)-N-[5-(4-methoxy-2-methyl-5-morpholin-4-ylcarbonyl-phenyl)sulfanyl-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Openeye Name: 5-(aminomethyl)-N-[5-[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]sulfanylthiazol-2-yl]-1H-pyrrole-2-carboxamide CAS Name: 5-(aminomethyl)-N-[5-[[4-methoxy-2-methyl-5-[4-morpholinyl(oxo)methyl]phenyl]thio]-2-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 5-(aminomethyl)-N-[5-[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]sulfanyl-1,3-thiazol-2-yl]-1H-pyrrole-2-carboxamide Traditional Name: 5-(aminomethyl)-N-[5-[[4-methoxy-2-methyl-5-(morpholine-4-carbonyl)phenyl]thio]thiazol-2-yl]-1H-pyrrole-2-carboxamide Formula: C22H25N5O4S2 MolecularWeight: 487.595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)OC)C(=O)N2CCOCC2)SC3=CN=C(S3)NC(=O)C4=CC=C(N4)CN

Isomeric SMILES

CC1=C(C=C(C(=C1)OC)C(=O)N2CCOCC2)SC3=CN=C(S3)NC(=O)C4=CC=C(N4)CN

InChI

InChI=1S/C22H25N5O4S2/c1-13-9-17(30-2)15(21(29)27-5-7-31-8-6-27)10-18(13)32-19-12-24-22(33-19)26-20(28)16-4-3-14(11-23)25-16/h3-4,9-10,12,25H,5-8,11,23H2,1-2H3,(H,24,26,28)