1-[3-chloranyl-4-[(R)-cyano(phenyl)methyl]phenyl]-3-methyl-thiourea

Systemtic Name: 1-[3-chloranyl-4-[(R)-cyano(phenyl)methyl]phenyl]-3-methyl-thiourea Openeye Name: 1-[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]-3-methyl-thiourea CAS Name: 1-[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]-3-methylthiourea IUPAC Name: 1-[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]-3-methylthiourea Traditional Name: 1-[3-chloro-4-[(R)-cyano(phenyl)methyl]phenyl]-3-methyl-thiourea Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC(=C(C=C1)C(C#N)C2=CC=CC=C2)Cl

Isomeric SMILES

CNC(=S)NC1=CC(=C(C=C1)[C@H](C#N)C2=CC=CC=C2)Cl

InChI

InChI=1S/C16H14ClN3S/c1-19-16(21)20-12-7-8-13(15(17)9-12)14(10-18)11-5-3-2-4-6-11/h2-9,14H,1H3,(H2,19,20,21)/t14-/m1/s1