1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(1-phenylethyl)thiourea

Systemtic Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(1-phenylethyl)thiourea Openeye Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(1-phenylethyl)thiourea CAS Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(1-phenylethyl)thiourea IUPAC Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(1-phenylethyl)thiourea Traditional Name: 1-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-(1-phenylethyl)thiourea Formula: C23H21N3S2 MolecularWeight: 403.56294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3S2/c1-15-8-13-20-21(14-15)28-22(26-20)18-9-11-19(12-10-18)25-23(27)24-16(2)17-6-4-3-5-7-17/h3-14,16H,1-2H3,(H2,24,25,27)