N-[3-(1,3-benzothiazol-2-yl)propyl]-4-cyano-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-cyano-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-cyano-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-cyanobenzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-cyanobenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-4-cyano-benzamide Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCNC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCNC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H15N3OS/c19-12-13-7-9-14(10-8-13)18(22)20-11-3-6-17-21-15-4-1-2-5-16(15)23-17/h1-2,4-5,7-10H,3,6,11H2,(H,20,22)