1-[4-(dimethylamino)-1,2-benzoxazol-3-yl]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[4-(dimethylamino)-1,2-benzoxazol-3-yl]-3-(4-methylphenyl)thiourea Openeye Name: 1-[4-(dimethylamino)-1,2-benzoxazol-3-yl]-3-(p-tolyl)thiourea CAS Name: 1-[4-(dimethylamino)-1,2-benzoxazol-3-yl]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[4-(dimethylamino)-1,2-benzoxazol-3-yl]-3-(4-methylphenyl)thiourea Traditional Name: 1-[4-(dimethylamino)indoxazen-3-yl]-3-(p-tolyl)thiourea Formula: C17H18N4OS MolecularWeight: 326.41602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=NOC3=CC=CC(=C32)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=NOC3=CC=CC(=C32)N(C)C

InChI

InChI=1S/C17H18N4OS/c1-11-7-9-12(10-8-11)18-17(23)19-16-15-13(21(2)3)5-4-6-14(15)22-20-16/h4-10H,1-3H3,(H2,18,19,20,23)