5-(1-adamantylcarbonyl)-4-azanyl-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(propan-2-ylamino)thiophene-3-carboxamide

Systemtic Name: 5-(1-adamantylcarbonyl)-4-azanyl-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-(propan-2-ylamino)thiophene-3-carboxamide Openeye Name: 5-(adamantane-1-carbonyl)-4-amino-N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(isopropylamino)thiophene-3-carboxamide CAS Name: 5-[1-adamantyl(oxo)methyl]-4-amino-N-(4-chloro-2-methoxy-5-methylphenyl)-2-(propan-2-ylamino)-3-thiophenecarboxamide IUPAC Name: 5-(adamantane-1-carbonyl)-4-amino-N-(4-chloro-2-methoxy-5-methylphenyl)-2-(propan-2-ylamino)thiophene-3-carboxamide Traditional Name: 5-(adamantane-1-carbonyl)-4-amino-N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(isopropylamino)thiophene-3-carboxamide Formula: C27H34ClN3O3S MolecularWeight: 516.09516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=C(SC(=C2N)C(=O)C34CC5CC(C3)CC(C5)C4)NC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=C(SC(=C2N)C(=O)C34CC5CC(C3)CC(C5)C4)NC(C)C

InChI

InChI=1S/C27H34ClN3O3S/c1-13(2)30-26-21(25(33)31-19-5-14(3)18(28)9-20(19)34-4)22(29)23(35-26)24(32)27-10-15-6-16(11-27)8-17(7-15)12-27/h5,9,13,15-17,30H,6-8,10-12,29H2,1-4H3,(H,31,33)