methyl 4-[(9-cyclopentyl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]-3-methyl-benzoate

Systemtic Name: methyl 4-[(9-cyclopentyl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]-3-methyl-benzoate Openeye Name: methyl 4-[(9-cyclopentyl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]-3-methyl-benzoate CAS Name: 4-[(9-cyclopentyl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[(9-cyclopentyl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]-3-methylbenzoate Traditional Name: 4-[(9-cyclopentyl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]-3-methyl-benzoic acid methyl ester Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)N=C2N(C3(CCCC3)CS2)C4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)N=C2N(C3(CCCC3)CS2)C4CCCC4

InChI

InChI=1S/C21H28N2O2S/c1-15-13-16(19(24)25-2)9-10-18(15)22-20-23(17-7-3-4-8-17)21(14-26-20)11-5-6-12-21/h9-10,13,17H,3-8,11-12,14H2,1-2H3