N-(1,3-benzothiazol-2-yl)-N-[(E)-furan-2-ylmethylideneamino]-3-phenylsulfanyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-furan-2-ylmethylideneamino]-3-phenylsulfanyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-2-furylmethyleneamino]-3-phenylsulfanyl-propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-2-furanylmethylideneamino]-3-(phenylthio)propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-furan-2-ylmethylideneamino]-3-phenylsulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-[(E)-2-furfurylideneamino]-3-(phenylthio)propionamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)N(C2=NC3=CC=CC=C3S2)N=CC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)N(C2=NC3=CC=CC=C3S2)/N=C/C4=CC=CO4

InChI

InChI=1S/C21H17N3O2S2/c25-20(12-14-27-17-8-2-1-3-9-17)24(22-15-16-7-6-13-26-16)21-23-18-10-4-5-11-19(18)28-21/h1-11,13,15H,12,14H2/b22-15+