4-azanyl-2-[(4-methoxyphenyl)amino]-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-carboxamide

Systemtic Name: 4-azanyl-2-[(4-methoxyphenyl)amino]-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-carboxamide Openeye Name: 4-amino-2-(4-methoxyanilino)-N-[(3S)-3-piperidyl]thiazole-5-carboxamide CAS Name: 4-amino-2-(4-methoxyanilino)-N-[(3S)-3-piperidinyl]-5-thiazolecarboxamide IUPAC Name: 4-amino-2-(4-methoxyanilino)-N-[(3S)-piperidin-3-yl]-1,3-thiazole-5-carboxamide Traditional Name: 4-amino-2-(p-anisidino)-N-[(3S)-3-piperidyl]thiazole-5-carboxamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=C(S2)C(=O)NC3CCCNC3)N

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=C(S2)C(=O)N[C@H]3CCCNC3)N

InChI

InChI=1S/C16H21N5O2S/c1-23-12-6-4-10(5-7-12)20-16-21-14(17)13(24-16)15(22)19-11-3-2-8-18-9-11/h4-7,11,18H,2-3,8-9,17H2,1H3,(H,19,22)(H,20,21)/t11-/m0/s1