[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]-(2-thiophen-3-yl-1,3-thiazol-4-yl)methanone

Systemtic Name: [4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]-(2-thiophen-3-yl-1,3-thiazol-4-yl)methanone Openeye Name: [4-(2-thienylmethyl)-1,4-diazepan-1-yl]-[2-(3-thienyl)thiazol-4-yl]methanone CAS Name: [4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]-[2-(3-thiophenyl)-4-thiazolyl]methanone IUPAC Name: [4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]-(2-thiophen-3-yl-1,3-thiazol-4-yl)methanone Traditional Name: [4-(2-thenyl)-1,4-diazepan-1-yl]-[2-(3-thienyl)thiazol-4-yl]methanone Formula: C18H19N3OS3 MolecularWeight: 389.55796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CSC(=N2)C3=CSC=C3)CC4=CC=CS4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CSC(=N2)C3=CSC=C3)CC4=CC=CS4

InChI

InChI=1S/C18H19N3OS3/c22-18(16-13-25-17(19-16)14-4-10-23-12-14)21-6-2-5-20(7-8-21)11-15-3-1-9-24-15/h1,3-4,9-10,12-13H,2,5-8,11H2