1-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]-1-methyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-[[5-(hydroxymethyl)-2-methyl-3-oxidanylidene-pyridin-4-ylidene]methylamino]-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridylidene]methylamino]-1-methyl-thiourea CAS Name: 1-[[5-(hydroxymethyl)-2-methyl-3-oxo-4-pyridinylidene]methylamino]-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[[5-(hydroxymethyl)-2-methyl-3-oxopyridin-4-ylidene]methylamino]-1-methylthiourea Traditional Name: 3-benzyl-1-[(3-keto-2-methyl-5-methylol-4-pyridylidene)methylamino]-1-methyl-thiourea Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=CNN(C)C(=S)NCC2=CC=CC=C2)C1=O)CO

Isomeric SMILES

CC1=NC=C(C(=CNN(C)C(=S)NCC2=CC=CC=C2)C1=O)CO

InChI

InChI=1S/C17H20N4O2S/c1-12-16(23)15(14(11-22)9-18-12)10-20-21(2)17(24)19-8-13-6-4-3-5-7-13/h3-7,9-10,20,22H,8,11H2,1-2H3,(H,19,24)