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

Systemtic Name: N-[4-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]-4-oxidanylidene-butyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-4-oxo-butyl]thiophene-2-carboxamide CAS Name: N-[4-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-4-oxobutyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-4-oxobutyl]thiophene-2-carboxamide Traditional Name: N-[4-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-4-keto-butyl]thiophene-2-carboxamide Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N3O2S2/c27-21(8-3-13-24-23(28)20-7-4-14-29-20)25-17-11-9-16(10-12-17)15-22-26-18-5-1-2-6-19(18)30-22/h1-2,4-7,9-12,14H,3,8,13,15H2,(H,24,28)(H,25,27)