1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(phenylmethyl)thiourea Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-benzyl-thiourea CAS Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-(phenylmethyl)thiourea IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-benzylthiourea Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)phenyl]-3-benzyl-thiourea Formula: C21H17N3S2 MolecularWeight: 375.50978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H17N3S2/c25-21(22-14-15-7-2-1-3-8-15)23-17-10-6-9-16(13-17)20-24-18-11-4-5-12-19(18)26-20/h1-13H,14H2,(H2,22,23,25)