1-[(E)-4-(2-methyl-1,3-dithiolan-2-yl)butan-2-ylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-4-(2-methyl-1,3-dithiolan-2-yl)butan-2-ylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[1-methyl-3-(2-methyl-1,3-dithiolan-2-yl)propylidene]amino]-3-phenyl-thiourea CAS Name: 1-[(E)-4-(2-methyl-1,3-dithiolan-2-yl)butan-2-ylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-4-(2-methyl-1,3-dithiolan-2-yl)butan-2-ylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-[1-methyl-3-(2-methyl-1,3-dithiolan-2-yl)propylidene]amino]-3-phenyl-thiourea Formula: C15H21N3S3 MolecularWeight: 339.54234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=CC=C1)CCC2(SCCS2)C

Isomeric SMILES

C/C(=N\NC(=S)NC1=CC=CC=C1)/CCC2(SCCS2)C

InChI

InChI=1S/C15H21N3S3/c1-12(8-9-15(2)20-10-11-21-15)17-18-14(19)16-13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3,(H2,16,18,19)/b17-12+