3-azanylidene-3-(5-methoxy-1,3-benzothiazol-2-yl)-2-[2-methyl-4-(phenylcarbonyl)piperazin-1-yl]propanenitrile

Systemtic Name: 3-azanylidene-3-(5-methoxy-1,3-benzothiazol-2-yl)-2-[2-methyl-4-(phenylcarbonyl)piperazin-1-yl]propanenitrile Openeye Name: 2-(4-benzoyl-2-methyl-piperazin-1-yl)-3-imino-3-(5-methoxy-1,3-benzothiazol-2-yl)propanenitrile CAS Name: 2-(4-benzoyl-2-methyl-1-piperazinyl)-3-imino-3-(5-methoxy-1,3-benzothiazol-2-yl)propanenitrile IUPAC Name: 2-(4-benzoyl-2-methylpiperazin-1-yl)-3-imino-3-(5-methoxy-1,3-benzothiazol-2-yl)propanenitrile Traditional Name: 2-(4-benzoyl-2-methyl-piperazino)-3-imino-3-(5-methoxy-1,3-benzothiazol-2-yl)propionitrile Formula: C23H23N5O2S MolecularWeight: 433.52602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(C#N)C(=N)C2=NC3=C(S2)C=CC(=C3)OC)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(C#N)C(=N)C2=NC3=C(S2)C=CC(=C3)OC)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H23N5O2S/c1-15-14-27(23(29)16-6-4-3-5-7-16)10-11-28(15)19(13-24)21(25)22-26-18-12-17(30-2)8-9-20(18)31-22/h3-9,12,15,19,25H,10-11,14H2,1-2H3