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

Systemtic Name: 1-[3-chloranyl-4-[(S)-cyano(phenyl)methyl]phenyl]-3-phenyl-thiourea Openeye Name: 1-[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]-3-phenyl-thiourea CAS Name: 1-[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]-3-phenylthiourea IUPAC Name: 1-[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]-3-phenylthiourea Traditional Name: 1-[3-chloro-4-[(S)-cyano(phenyl)methyl]phenyl]-3-phenyl-thiourea Formula: C21H16ClN3S MolecularWeight: 377.88984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C2=C(C=C(C=C2)NC(=S)NC3=CC=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C#N)C2=C(C=C(C=C2)NC(=S)NC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H16ClN3S/c22-20-13-17(25-21(26)24-16-9-5-2-6-10-16)11-12-18(20)19(14-23)15-7-3-1-4-8-15/h1-13,19H,(H2,24,25,26)/t19-/m0/s1