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

Systemtic Name: N-[3-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]-3-oxidanylidene-propyl]thiophene-2-carboxamide Openeye Name: N-[3-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-3-oxo-propyl]thiophene-2-carboxamide CAS Name: N-[3-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-3-oxopropyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-3-oxopropyl]thiophene-2-carboxamide Traditional Name: N-[3-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-3-keto-propyl]thiophene-2-carboxamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3O2S2/c26-20(11-12-23-22(27)19-6-3-13-28-19)24-16-9-7-15(8-10-16)14-21-25-17-4-1-2-5-18(17)29-21/h1-10,13H,11-12,14H2,(H,23,27)(H,24,26)