N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-2-chloranyl-benzamide

Systemtic Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-2-chloranyl-benzamide Openeye Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxo-propyl]-2-chloro-benzamide CAS Name: N-[3-(2-benzo[e][1,3]benzothiazolylamino)-3-oxopropyl]-2-chlorobenzamide IUPAC Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-oxopropyl]-2-chlorobenzamide Traditional Name: N-[3-(benzo[e][1,3]benzothiazol-2-ylamino)-3-keto-propyl]-2-chloro-benzamide Formula: C21H16ClN3O2S MolecularWeight: 409.88864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)CCNC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2N=C(S3)NC(=O)CCNC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H16ClN3O2S/c22-16-8-4-3-7-15(16)20(27)23-12-11-18(26)24-21-25-19-14-6-2-1-5-13(14)9-10-17(19)28-21/h1-10H,11-12H2,(H,23,27)(H,24,25,26)