4-methyl-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-3-pyrrol-1-yl-benzamide

Systemtic Name: 4-methyl-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-3-pyrrol-1-yl-benzamide Openeye Name: 4-methyl-N-[(5-morpholinosulfonyl-2-thienyl)methyl]-3-pyrrol-1-yl-benzamide CAS Name: 4-methyl-N-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methyl]-3-(1-pyrrolyl)benzamide IUPAC Name: 4-methyl-N-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-3-pyrrol-1-ylbenzamide Traditional Name: 4-methyl-N-[(5-morpholinosulfonyl-2-thienyl)methyl]-3-pyrrol-1-yl-benzamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3)N4C=CC=C4

InChI

InChI=1S/C21H23N3O4S2/c1-16-4-5-17(14-19(16)23-8-2-3-9-23)21(25)22-15-18-6-7-20(29-18)30(26,27)24-10-12-28-13-11-24/h2-9,14H,10-13,15H2,1H3,(H,22,25)