1-[(5-bromanylindol-3-ylidene)methylamino]-1-methyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(5-bromanylindol-3-ylidene)methylamino]-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(5-bromoindol-3-ylidene)methylamino]-1-methyl-thiourea CAS Name: 1-[(5-bromo-3-indolylidene)methylamino]-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(5-bromoindol-3-ylidene)methylamino]-1-methylthiourea Traditional Name: 3-benzyl-1-[(5-bromoindol-3-ylidene)methylamino]-1-methyl-thiourea Formula: C18H17BrN4S MolecularWeight: 401.32338

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCC1=CC=CC=C1)NC=C2C=NC3=C2C=C(C=C3)Br

Isomeric SMILES

CN(C(=S)NCC1=CC=CC=C1)NC=C2C=NC3=C2C=C(C=C3)Br

InChI

InChI=1S/C18H17BrN4S/c1-23(18(24)21-10-13-5-3-2-4-6-13)22-12-14-11-20-17-8-7-15(19)9-16(14)17/h2-9,11-12,22H,10H2,1H3,(H,21,24)