1-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one

Systemtic Name: 1-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one Openeye Name: 1-[4-[(5-phenyl-2-thienyl)methyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one CAS Name: 1-[4-[(5-phenyl-2-thiophenyl)methyl]-1-piperazinyl]-3-(1,2,4-triazol-1-yl)-1-propanone IUPAC Name: 1-[4-[(5-phenylthiophen-2-yl)methyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-1-one Traditional Name: 1-[4-[(5-phenyl-2-thienyl)methyl]piperazino]-3-(1,2,4-triazol-1-yl)propan-1-one Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC=CC=C3)C(=O)CCN4C=NC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC=CC=C3)C(=O)CCN4C=NC=N4

InChI

InChI=1S/C20H23N5OS/c26-20(8-9-25-16-21-15-22-25)24-12-10-23(11-13-24)14-18-6-7-19(27-18)17-4-2-1-3-5-17/h1-7,15-16H,8-14H2