1-phenyl-3-[2-[3-(phenylcarbamothioylamino)pyridin-2-yl]pyridin-3-yl]thiourea

Systemtic Name: 1-phenyl-3-[2-[3-(phenylcarbamothioylamino)pyridin-2-yl]pyridin-3-yl]thiourea Openeye Name: 1-phenyl-3-[2-[3-(phenylcarbamothioylamino)-2-pyridyl]-3-pyridyl]thiourea CAS Name: 1-[2-[3-[[anilino(sulfanylidene)methyl]amino]-2-pyridinyl]-3-pyridinyl]-3-phenylthiourea IUPAC Name: 1-phenyl-3-[2-[3-(phenylcarbamothioylamino)pyridin-2-yl]pyridin-3-yl]thiourea Traditional Name: 1-phenyl-3-[2-[3-(phenylthiocarbamoylamino)-2-pyridyl]-3-pyridyl]thiourea Formula: C24H20N6S2 MolecularWeight: 456.5858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NC2=C(N=CC=C2)C3=C(C=CC=N3)NC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NC2=C(N=CC=C2)C3=C(C=CC=N3)NC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C24H20N6S2/c31-23(27-17-9-3-1-4-10-17)29-19-13-7-15-25-21(19)22-20(14-8-16-26-22)30-24(32)28-18-11-5-2-6-12-18/h1-16H,(H2,27,29,31)(H2,28,30,32)