1-[3-oxidanylidene-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[3-oxidanylidene-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[3-oxo-3-[4-(3-thienylmethyl)piperazin-1-yl]propyl]urea CAS Name: 1-[3-oxo-3-[4-(3-thiophenylmethyl)-1-piperazinyl]propyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[3-oxo-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]propyl]urea Traditional Name: 1-benzyl-3-[3-keto-3-[4-(3-thenyl)piperazino]propyl]urea Formula: C20H26N4O2S MolecularWeight: 386.51104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)CCNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)CCNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H26N4O2S/c25-19(6-8-21-20(26)22-14-17-4-2-1-3-5-17)24-11-9-23(10-12-24)15-18-7-13-27-16-18/h1-5,7,13,16H,6,8-12,14-15H2,(H2,21,22,26)