1-[(Z)-[5-bromanyl-6-methyl-1-[(4-methylpiperidin-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]thiourea

Systemtic Name: 1-[(Z)-[5-bromanyl-6-methyl-1-[(4-methylpiperidin-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]thiourea Openeye Name: [(Z)-[5-bromo-6-methyl-1-[(4-methyl-1-piperidyl)methyl]-2-oxo-indolin-3-ylidene]amino]thiourea CAS Name: [(Z)-[5-bromo-6-methyl-1-[(4-methyl-1-piperidinyl)methyl]-2-oxo-3-indolylidene]amino]thiourea IUPAC Name: [(Z)-[5-bromo-6-methyl-1-[(4-methylpiperidin-1-yl)methyl]-2-oxoindol-3-ylidene]amino]thiourea Traditional Name: [(Z)-[5-bromo-2-keto-6-methyl-1-[(4-methylpiperidino)methyl]indolin-3-ylidene]amino]thiourea Formula: C17H22BrN5OS MolecularWeight: 424.35848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CN2C3=CC(=C(C=C3C(=NNC(=S)N)C2=O)Br)C

Isomeric SMILES

CC1CCN(CC1)CN2C3=CC(=C(C=C3/C(=N/NC(=S)N)/C2=O)Br)C

InChI

InChI=1S/C17H22BrN5OS/c1-10-3-5-22(6-4-10)9-23-14-7-11(2)13(18)8-12(14)15(16(23)24)20-21-17(19)25/h7-8,10H,3-6,9H2,1-2H3,(H3,19,21,25)/b20-15-