N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(thiophen-2-ylsulfonylamino)propanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(thiophen-2-ylsulfonylamino)propanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(2-thienylsulfonylamino)propanamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(thiophen-2-ylsulfonylamino)propanamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(thiophen-2-ylsulfonylamino)propanamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-3-(2-thienylsulfonylamino)propionamide Formula: C21H19N3O3S3 MolecularWeight: 457.58886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CC3=CC=C(C=C3)NC(=O)CCNS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CC3=CC=C(C=C3)NC(=O)CCNS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H19N3O3S3/c25-19(11-12-22-30(26,27)21-6-3-13-28-21)23-16-9-7-15(8-10-16)14-20-24-17-4-1-2-5-18(17)29-20/h1-10,13,22H,11-12,14H2,(H,23,25)