3-[(Z)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(Z)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(Z)-[5-(1-piperidyl)-2-thienyl]methyleneamino]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(Z)-[5-(1-piperidinyl)-2-thiophenyl]methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(Z)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(Z)-(5-piperidino-2-thienyl)methyleneamino]-2-thioxo-1H-quinazolin-4-one Formula: C18H18N4OS2 MolecularWeight: 370.49172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(S2)C=NN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CCN(CC1)C2=CC=C(S2)/C=N\N3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C18H18N4OS2/c23-17-14-6-2-3-7-15(14)20-18(24)22(17)19-12-13-8-9-16(25-13)21-10-4-1-5-11-21/h2-3,6-9,12H,1,4-5,10-11H2,(H,20,24)/b19-12-