1-[[1-cyclohexyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]-3-phenyl-thiourea

Systemtic Name: 1-[[1-cyclohexyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]-3-phenyl-thiourea Openeye Name: 1-[(1-cyclohexyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-3-phenyl-thiourea CAS Name: 1-[(1-cyclohexyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-3-phenylthiourea IUPAC Name: 1-[(1-cyclohexyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]-3-phenylthiourea Traditional Name: 1-[(1-cyclohexyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]-3-phenyl-thiourea Formula: C18H21N5O2S2 MolecularWeight: 403.52164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C(=CNNC(=S)NC3=CC=CC=C3)C(=O)NC2=S

Isomeric SMILES

C1CCC(CC1)N2C(=O)C(=CNNC(=S)NC3=CC=CC=C3)C(=O)NC2=S

InChI

InChI=1S/C18H21N5O2S2/c24-15-14(11-19-22-17(26)20-12-7-3-1-4-8-12)16(25)23(18(27)21-15)13-9-5-2-6-10-13/h1,3-4,7-8,11,13,19H,2,5-6,9-10H2,(H2,20,22,26)(H,21,24,27)