1-[(E)-[2-bromanyl-1-(4-methylphenyl)carbonyl-indol-3-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[2-bromanyl-1-(4-methylphenyl)carbonyl-indol-3-yl]methylideneamino]thiourea Openeye Name: [(E)-[2-bromo-1-(4-methylbenzoyl)indol-3-yl]methyleneamino]thiourea CAS Name: [(E)-[2-bromo-1-[(4-methylphenyl)-oxomethyl]-3-indolyl]methylideneamino]thiourea IUPAC Name: [(E)-[2-bromo-1-(4-methylbenzoyl)indol-3-yl]methylideneamino]thiourea Traditional Name: [(E)-(2-bromo-1-p-toluoyl-indol-3-yl)methyleneamino]thiourea Formula: C18H15BrN4OS MolecularWeight: 415.3069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C(=C2Br)C=NNC(=S)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C3=CC=CC=C3C(=C2Br)/C=N/NC(=S)N

InChI

InChI=1S/C18H15BrN4OS/c1-11-6-8-12(9-7-11)17(24)23-15-5-3-2-4-13(15)14(16(23)19)10-21-22-18(20)25/h2-10H,1H3,(H3,20,22,25)/b21-10+