N-[3-[[4-(1,3-benzothiazol-2-yl)phenyl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[[4-(1,3-benzothiazol-2-yl)phenyl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[4-(1,3-benzothiazol-2-yl)anilino]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[4-(1,3-benzothiazol-2-yl)anilino]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[4-(1,3-benzothiazol-2-yl)anilino]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[4-(1,3-benzothiazol-2-yl)anilino]-3-keto-propyl]thiophene-3-carboxamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCNC(=O)C4=CSC=C4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCNC(=O)C4=CSC=C4

InChI

InChI=1S/C21H17N3O2S2/c25-19(9-11-22-20(26)15-10-12-27-13-15)23-16-7-5-14(6-8-16)21-24-17-3-1-2-4-18(17)28-21/h1-8,10,12-13H,9,11H2,(H,22,26)(H,23,25)